{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.302275 0.3737398 2.647818 ] [ 0.2826825 1.480501 1.727575 ] [ 0.6414777 2.53008 2.452953 ] [ 2.763361 0.4669357 0.177905 ] [ 2.062003 2.101671 0.3497139 ] [ 2.601995 2.989286 1.853157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.302275e-10 3.737398e-11 2.647818e-10 ] [ 2.826825e-11 1.480501e-10 1.727575e-10 ] [ 6.414777000000001e-11 2.53008e-10 2.452953e-10 ] [ 2.763361e-10 4.669357e-11 1.77905e-11 ] [ 2.062003e-10 2.101671e-10 3.497139e-11 ] [ 2.601995e-10 2.989286e-10 1.853157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 13.8805651 -19.9017852 13.5416761 ] [ -50.1581151 -69.5322331 -66.400685 ] [ 14.1759316 83.1215666 64.4753308 ] [ 7.6019316 -16.175892 -2.7614244 ] [ -5.7556317 5.1209781 -22.5876138 ] [ 20.2553185 17.3673657 13.7327164 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.223911706993587e-08 -3.188617522232701e-08 2.169615703261625e-08 ] [ -8.036216001870257e-08 -1.114029191826614e-07 -1.063856259885943e-07 ] [ 2.271234637470223e-08 1.331754317879948e-07 1.033008684771805e-07 ] [ 1.217963718278623e-08 -2.591663619650753e-08 -4.42428965023747e-09 ] [ -9.221538623649698e-09 8.204711455045715e-09 -3.618934704817595e-08 ] [ 3.245259801492793e-08 2.782558751867305e-08 2.200223733742859e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 33.053258 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.295715764517357e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1884263 -0.7841197 3.0107921 ] [ 0.4562099 1.2511455 1.9841194 ] [ 0.8274808 3.3462585 3.0508931 ] [ 3.6673757 0.4165481 -0.5578755 ] [ 2.0715191 1.8086305 0.3272098 ] [ 2.4427824 3.9037506 1.393983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.884263e-11 -7.841197e-11 3.0107921e-10 ] [ 4.562099e-11 1.2511455e-10 1.9841194e-10 ] [ 8.274808e-11 3.3462585e-10 3.0508931e-10 ] [ 3.6673757e-10 4.165481e-11 -5.578755e-11 ] [ 2.0715191e-10 1.8086305e-10 3.272098e-11 ] [ 2.4427824e-10 3.9037506e-10 1.393983e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.4e-06 3.38e-05 -3.8e-06 ] [ 1.82e-05 2.5e-06 -1.2e-05 ] [ -7.4e-06 1.56e-05 1.91e-05 ] [ 5.72e-05 -2.16e-05 -5.15e-05 ] [ -3.81e-05 1.57e-05 5.32e-05 ] [ -2.45e-05 -4.6e-05 -4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.6517538236e-15 5.415357022919999e-14 -6.088271209199999e-15 ] [ 2.915961473879999e-14 4.005441585e-15 -1.9226119608e-14 ] [ -1.18561070916e-14 2.49939554904e-14 3.06015737094e-14 ] [ 9.164450346479999e-14 -3.46070152944e-14 -8.251209665099998e-14 ] [ -6.10429297554e-14 2.515417315379999e-14 8.523579692879999e-14 ] [ -3.925332753299999e-14 -7.370012516399999e-14 -7.850665506599998e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.967209 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.23779359019945e-18 } }